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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7n2v

Legend

Pocket colors by molecule type

 RNA

 Protein

 DNA

These colors appear when a pocket is selected (the structure fades to show the pocket surface). Colors from the molecule-type palette (RNA / protein / DNA).

System information

Experimental technique Electron Microscopy
Experimental resolution 2.54
System mass 2349.54 kDa
Deposition year 2021
Molecule type RNA/Protein
# RNA entities 1
Organism Escherichia
RCSB PDB Entry 7n2v
Reference Rundlet Emily J., Holm Mikael, Schacherl Magdalena, Natchiar S. Kundhavai, Altman Roger B., Spahn Christian M. T., Myasnikov Alexander G., Blanchard Scott C.. 2021. Structural basis of early translocation events on the ribosome Nature
Equivalence Class NR_all_83717.187, NR_all_56726.172
BGSU version: 4.52

Pockets List

Legend

Cell colors for SiteScore and D Score:

 Favourable

 Intermediate

 Unfavourable

 Not available

ScoreThresholdMeaning
SiteScore< 0.8Non-drug binding site
SiteScore0.8 – 1.0Potential drug binding site
SiteScore> 1.0Promising binding site
D Score< 0.83Undruggable
D Score0.83 – 0.98Difficult
D Score> 0.98Druggable

Tick a pocket below to highlight it in the 3D structure above.

Compound ATP
Residue . / 3002
Chain CE / 23
Non-redundant True
Interacting RNA chains W/23
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains W/23: rRNA
RNA family global rRNA
Volume 40.82 Å3
Hydrophobicity 0.442
Hydrophilicity 1.004
Buriedness 0.592
Don/acc character 0.965
SiteScore 0.477
D Score 0.380
Kd

Compound ATP
Residue . / 3003
Chain DE / 23
Non-redundant True
Interacting RNA chains W/23
RNA environment detailled RNA-only
RNA environment global RNA
RNA family chains W/23: rRNA
RNA family global rRNA
Volume 151.61 Å3
Hydrophobicity 0.330
Hydrophilicity 1.254
Buriedness 0.649
Don/acc character 1.321
SiteScore 1.006
D Score 0.778
Kd

Compound GTP
Residue . / 901
Chain MP / EF
Non-redundant True
Interacting RNA chains W/23
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains W/23: rRNA
RNA family global rRNA
Volume 465.45 Å3
Hydrophobicity 0.141
Hydrophilicity 1.991
Buriedness 0.855
Don/acc character 0.661
SiteScore 1.105
D Score 0.804
Kd

Compound SCM
Residue . / 1601
Chain HB / 16
Non-redundant True
Interacting RNA chains A/16
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains A/16: rRNA
RNA family global rRNA
Volume 739.85 Å3
Hydrophobicity 0.134
Hydrophilicity 1.379
Buriedness 0.781
Don/acc character 1.595
SiteScore 1.206
D Score 0.959
Kd

Compound SCM
Residue . / 1602
Chain IB / 16
Non-redundant True
Interacting RNA chains A/16
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains A/16: rRNA
RNA family global rRNA
Volume 60.37 Å3
Hydrophobicity 0.060
Hydrophilicity 1.104
Buriedness 0.547
Don/acc character 1.189
SiteScore 0.618
D Score 0.356
Kd

Compound SCM
Residue . / 3001
Chain BE / 23
Non-redundant True
Interacting RNA chains W/23
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains W/23: rRNA
RNA family global rRNA
Volume -
Hydrophobicity -
Hydrophilicity -
Buriedness -
Don/acc character -
SiteScore -
D Score -
Kd